SCHEMBL17412414

SCHEMBL17412414

CC1(C)c2ccccc2-c2c(N(c3ccccc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc3)cccc21

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSPO P30536 6/20 0.39
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HDAC4 P56524 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24221718 0.99 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL23376306 0.98 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL21446540 0.98 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL30266355 0.97 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL24221714 0.97 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14681454 0.97 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL24221831 0.97 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL30196840 0.97 TSPO (0.39) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14681322 0.97 TSPO (0.37) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14681448 0.97 TSPO (0.34) TSPO

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016003225-A2 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2016-01-07 WO disclosed